2-chloranyl-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[3-methoxy-4-[(2-methyl-1-oxopropyl)amino]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-(isobutyrylamino)-3-methoxy-phenyl]-4-nitro-benzamide Formula: C18H18ClN3O5 MolecularWeight: 391.80562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)OC

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)OC

InChI

InChI=1S/C18H18ClN3O5/c1-10(2)17(23)21-15-7-4-11(8-16(15)27-3)20-18(24)13-6-5-12(22(25)26)9-14(13)19/h4-10H,1-3H3,(H,20,24)(H,21,23)